2-(3,4-dinitrophenoxy)-1-ethyl-pyridin-1-ium

Systemtic Name: 2-(3,4-dinitrophenoxy)-1-ethyl-pyridin-1-ium Openeye Name: 2-(3,4-dinitrophenoxy)-1-ethyl-pyridin-1-ium CAS Name: 2-(3,4-dinitrophenoxy)-1-ethylpyridin-1-ium IUPAC Name: 2-(3,4-dinitrophenoxy)-1-ethylpyridin-1-ium Traditional Name: 2-(3,4-dinitrophenoxy)-1-ethyl-pyridin-1-ium Formula: C13H12N3O5+ MolecularWeight: 290.25148

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC=C1OC2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC[N+]1=CC=CC=C1OC2=CC(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12N3O5/c1-2-14-8-4-3-5-13(14)21-10-6-7-11(15(17)18)12(9-10)16(19)20/h3-9H,2H2,1H3/q+1